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Details

Stereochemistry ACHIRAL
Molecular Formula C37H35N2O6S2.Na
Molecular Weight 690.803
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACID BLUE 7

SMILES

[Na+].CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=C3C=CC(C=C3)=[N+](CC)CC4=CC=CC=C4)C5=CC=C(C=C5S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=FTUYQIPAPWPHNC-UHFFFAOYSA-M
InChI=1S/C37H36N2O6S2.Na/c1-3-38(26-28-11-7-5-8-12-28)32-19-15-30(16-20-32)37(35-24-23-34(46(40,41)42)25-36(35)47(43,44)45)31-17-21-33(22-18-31)39(4-2)27-29-13-9-6-10-14-29;/h5-25H,3-4,26-27H2,1-2H3,(H-,40,41,42,43,44,45);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C37H35N2O6S2
Molecular Weight 667.814
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:35:25 GMT 2023
Edited
by admin
on Sat Dec 16 11:35:25 GMT 2023
Record UNII
014OZV4W1O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID BLUE 7
Common Name English
C.I. 42080
Common Name English
C.I. ACID BLUE 7
Common Name English
CI 42080
INCI  
INCI  
Official Name English
SODIUM 4-((4-(BENZYL-ETHYLAMINO)PHENYL)-(4-(BENZYL-ETHYLAZANIUMYLIDENE)-1-CYCLOHEXA-2,5-DIENYLIDENE)METHYL)BENZENE-1,3-DISULFONATE
Systematic Name English
PATENT BLUE A
Common Name English
ACID SKY BLUE O
Common Name English
ALPHAZURINE A
Common Name English
BENZENEMETHANAMINIUM, N-(4-((2,4-DISULFOPHENYL)(4-(ETHYL(PHENYLMETHYL)AMINO)PHENYL)METHYLENE)-2,5-CYCLOHEXADIEN-1-YLIDENE)-N-ETHYL-, INNER SALT, SODIUM SALT (1:1)
Common Name English
SODIUM 4-((4-(BENZYL(ETHYL)AMINO)PHENYL)(4-(BENZYL(ETHYL)IMINIO)CYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL)BENZENE-1,3-DISULFONATE
Systematic Name English
D&C BLUE NO. 3 (DELISTED)
Common Name English
CI 42080 [INCI]
Common Name English
ERIO GLAUCINE X
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
222-476-0
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
PRIMARY
CAS
94082-73-2
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
ALTERNATIVE
EPA CompTox
DTXSID80881399
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
PRIMARY
FDA UNII
014OZV4W1O
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
PRIMARY
CAS
3486-30-4
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
PRIMARY
PUBCHEM
62498
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
PRIMARY
CAS
1264431-24-4
Created by admin on Sat Dec 16 11:35:25 GMT 2023 , Edited by admin on Sat Dec 16 11:35:25 GMT 2023
ALTERNATIVE
Related Record Type Details
PARENT -> SALT/SOLVATE